Geometry & MOs

Info

ID:	402749
PubChem CID:	135057127
Reduced:	OC14H18 (1)
Stoich.:	AB14C18 (1)
Weight, g/mol:	194.079908
ΔH_f, kcal/mol:	-30.92
Dipole, Da:	2.41
IP(EA), eV:	-9.16(0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-tert-butylsulfinylsulfanylbutane

Drug info:

PubChemData

Smile

C[C@H](C=C)[C@@]1(CCCC2=CC=CC=C21)O

DOS

IR

Vibrations